SCHEMBL5941567

SCHEMBL5941567

CC(C)C[C@H](NC(=O)c1ccc(N(C)C)cc1)C(=O)N1CC[C@@H]2[C@H]1C(=O)CN2C(=O)c1ccc(S(C)(=O)=O)s1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 16/20 0.71
CTSS P25774 4/20 0.43
CTSL P07711 3/20 0.35
CTSB P07858 1/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA9 Q16790 2/20 0.35
CCR1 P32246 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5941570 1.00 CTSK (0.71) CTSKCTSSCTSLCTSBCA12
SCHEMBL4043486 0.89 CTSK (0.74) CTSKCTSSCCR1
SCHEMBL5941969 0.89 CTSK (0.74) CTSKCTSSCCR1
SCHEMBL5941972 0.89 CTSK (0.74) CTSKCTSSCCR1
SCHEMBL13909111 0.87 CTSK (0.72) CTSKCTSSCTSLCA12CA1
SCHEMBL4219111 0.85 CTSK (0.78) CTSKCTSSCTSLCCR1
SCHEMBL5941619 0.85 CTSK (0.78) CTSKCTSSCTSLCCR1
SCHEMBL4219105 0.85 CTSK (0.78) CTSKCTSSCTSLCCR1
SCHEMBL4038504 0.85 CTSK (0.78) CTSKCTSSCTSLCCR1
SCHEMBL5941785 0.84 CTSK (0.80) CTSKCTSSCTSLCTSBCA12

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060100431-A1 Biologically active compounds AMURA THERAPEUTICS LIMITED (GB) 2006-05-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060100431-A1 Biologically active compounds SOST, CTSK, CTSS CTSK 2/4885CTSS 3/4885CTSL 57/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.